SCHEMBL920722

SCHEMBL920722

Nc1ncccc1C(=O)NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.61
MAPK8 P45983 1/20 0.55
HDAC6 Q9UBN7 1/20 0.54
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HPGD P15428 2/20 0.51
CYP3A4 P08684 1/20 0.48
HTT P42858 1/20 0.48
MMP13 P45452 1/20 0.48
SORT1 Q99523 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL921323 0.91 MAPK14 (0.57) MAPK14MAPK8HPGD
SCHEMBL919622 0.91 MAPK14 (0.54) MAPK14MAPK8HDAC6
SCHEMBL920489 0.89 MAPK14 (0.48) MAPK14MAPK8HDAC6LMNASMN1; SMN2
SCHEMBL921976 0.89 MAPK8 (0.52) MAPK14MAPK8HDAC6LMNASMN1; SMN2
SCHEMBL921058 0.88 KCNQ3 (0.48) MAPK14MAPK8HDAC6SORT1
SCHEMBL920958 0.88 MAPK14 (0.47) MAPK14MAPK8HDAC6SORT1
SCHEMBL920343 0.87 KMT2A (0.61) MAPK14MAPK8LMNASMN1; SMN2HPGD
SCHEMBL922539 0.87 FFAR1 (0.52) MAPK14MAPK8HDAC6HPGDHTT
SCHEMBL920461 0.87 MAPK8 (0.67) MAPK14MAPK8LMNASMN1; SMN2HPGD
SCHEMBL922737 0.86 MAPK8 (0.47) MAPK14MAPK8HDAC6LMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 MAPK14 905/4885MAPK8 2313/4885HDAC6 401/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.